COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550760
Chemical Name: 3-butyl-5-imino-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: CCCCC1OC2(C)OC(=N)C1(C#N)C(C2c1ccccc1)(C#N)C#N

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Molecular Weight: 348.4
Empirical Formula: C20H20N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.385
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 113
Number of rings: 4

     

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